2-Chloro-5-methylthiophene

C₅H₅ClSCAS 17249-82-0132.61 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅ClS
Molar mass: 132.61 g/mol
Exact mass: 131.9800 Da
logP: 2.71Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

17249-82-0

SMILES

CC1=CC=C(S1)Cl

InChIKey

JSMMZMYGEVUURX-UHFFFAOYSA-N

InChI

InChI=1S/C5H5ClS/c1-4-2-3-5(6)7-4/h2-3H,1H3

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Names and synonyms

1 names

Thiophene, 2-chloro-5-methyl-

Work with 2-Chloro-5-methylthiophene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,5-Dichlorothiophene3172-52-958 % similar 2,5-Dimethylthiophene638-02-858 % similar 2-Bromo-5-chlorothiophene2873-18-944 % similar 2-Bromo-5-methylthiophene765-58-244 % similar 2-Chloro-5-(chloromethyl)thiophene23784-96-541 % similar 2-Acetyl-5-chlorothiophene6310-09-440 % similar 5-Methyl-2-thiophenecarboxaldehyde13679-70-439 % similar 5-Methyl-2-thiopheneboronic acid162607-20-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Chloro-3-methylthiophene14345-97-2 2-chloromethylThiophene765-50-4

Elsewhere

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